General Information of the Compound
| Compound ID |
CP0426938
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| Compound Name |
2-(4-chlorophenoxy)-N-[2-(4-hydroxy-4-methylpiperidin-1-yl)-4-methylquinazolin-6-yl]acetamide
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| Structure |
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| Formula |
C23H25ClN4O3
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| Molecular Weight |
440.931
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| Canonical SMILES |
Cc1nc(nc2ccc(NC(=O)COc3ccc(Cl)cc3)cc12)N1CCC(C)(O)CC1
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| InChI |
InChI=1S/C23H25ClN4O3/c1-15-19-13-17(26-21(29)14-31-18-6-3-16(24)4-7-18)5-8-20(19)27-22(25-15)28-11-9-23(2,30)10-12-28/h3-8,13,30H,9-12,14H2,1-2H3,(H,26,29)
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| InChIKey |
RYQOIJFVLVAMNR-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound